Identification and Characterization of Volatile Organic Compounds Based on GC-IMS Technology in Different Organs of Lilium brownii var. viridulum and After Bud-Removal and Non-Bud-Removal Treatments
Abstract
:1. Introduction
2. Results and Discussion
2.1. GC-IMS Spectroscopic Analysis of Longya Lily
2.2. Identification of Volatile Organic Compounds in Longya Lily
2.3. Fingerprint Mapping Study
2.3.1. Fingerprinting Study of VOCs in Different Organs of Longya Lilies
2.3.2. Fingerprinting of VOCs in Longya Lilies Undergoing Bud-Removal and Non-Bud-Removal Treatments
2.4. Multivariate Statistical Analysis
2.4.1. Principal Component Analysis and Correlation Study of VOCs in Different Organs of Longya Lily
2.4.2. Principal Component Analysis and Correlation Study of VOCs in Longya Lilies After Bud-Removal and Non-Bud-Removal Treatments
2.4.3. Volatile Organic Compounds
3. Materials and Methods
3.1. Sample Preparation and Collection
3.2. Chemicals and Instruments
3.3. GC-IMS Analysis
3.4. Statistical Analysis
4. Conclusions
Supplementary Materials
Author Contributions
Funding
Institutional Review Board Statement
Informed Consent Statement
Data Availability Statement
Conflicts of Interest
Abbreviations
GC-IMS | Gas chromatography–ion mobility spectrometry |
VOCs | Volatile organic compounds |
E-nose | Electronic nose |
GC-O | Gas chromatography–olfactometry |
OPLS-DA | Partial least squares discriminant analysis |
VIP | Variable importance |
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Count | Compound | CAS# | Formula | MW | RI | Rt [sec] | Dt [a.u.] | Flavor Description |
---|---|---|---|---|---|---|---|---|
1 | 1 | unidentified | * | 0 | 1169.9 | 376.591 | 1.19667 | / |
2 | 2 | unidentified | * | 0 | 1460.6 | 862.462 | 1.20404 | / |
3 | methyl benzoate-D | C93583 | C8H8O2 | 136.1 | 1583.5 | 1162.145 | 1.59803 | wintergreen, almond, floral, cananga |
4 | methyl benzoate-M | C93583 | C8H8O2 | 136.1 | 1583 | 1160.532 | 1.22269 | wintergreen, almond, floral, cananga |
5 | Acetic acid-D | C64197 | C2H4O2 | 60.1 | 1466.7 | 875.513 | 1.16392 | spicy |
6 | Acetic acid-M | C64197 | C2H4O2 | 60.1 | 1463.9 | 869.582 | 1.05376 | spicy |
7 | Benzaldehyde-M | C100527 | C7H6O | 106.1 | 1495.9 | 939.747 | 1.14947 | bitter almond, cherry, nutty |
8 | Benzaldehyde-D | C100527 | C7H6O | 106.1 | 1495.9 | 939.747 | 1.46835 | bitter almond, cherry, nutty |
9 | 1-Octanol | C111875 | C8H18O | 130.2 | 1554.4 | 1083.003 | 1.47033 | citrus, sweet, herbs, waxy, rose, mushroom |
10 | Propanoic acid | C79094 | C3H6O2 | 74.1 | 1543.5 | 1054.513 | 1.10979 | yogurt, vinegar |
11 | phenylacetaldehyde-M | C122781 | C8H8O | 120.2 | 1610.2 | 1239.896 | 1.25793 | hyacinth, sweet fruity, almond, cherry, clover honey, cocoa |
12 | phenylacetaldehyde-D | C122781 | C8H8O | 120.2 | 1608 | 1233.039 | 1.53866 | hyacinth, sweet fruity, almond, cherry, clover honey, cocoa |
13 | (E,E)-2,4-heptadienal | C4313035 | C7H10O | 110.2 | 1477.8 | 899.391 | 1.19427 | fatty, oily, aldehyde, vegetable, cinnamon |
14 | (Z)-3-hexenol-D | C928961 | C6H12O | 100.2 | 1397.7 | 740.494 | 1.50195 | green, herb |
15 | (Z)-3-hexenol-M | C928961 | C6H12O | 100.2 | 1399.3 | 743.433 | 1.2367 | green, herb |
16 | (E)-Ethyl-2-hexenoate-D | C27829727 | C8H14O2 | 142.2 | 1336.6 | 638.609 | 1.80277 | fruity, vegetable |
17 | (E)-Ethyl-2-hexenoate-M | C27829727 | C8H14O2 | 142.2 | 1337.1 | 639.327 | 1.33034 | fruity, vegetable |
18 | (Z)-2-Penten-1-ol | C1576950 | C5H10O | 86.1 | 1345.6 | 652.643 | 0.94494 | green, plastic, rubber |
19 | 1-Penten-3-ol | C616251 | C5H10O | 86.1 | 1175.1 | 383.645 | 0.94119 | ethereal, green, tropical fruity |
20 | (E)-2-Heptenal-D | C18829555 | C7H12O | 112.2 | 1340.7 | 644.937 | 1.66537 | spicy, green vegetables, fresh, fatty |
21 | nonanal-M | C124196 | C9H18O | 142.2 | 1396.2 | 737.808 | 1.47457 | rose, citrus, strong oily |
22 | nonanal-D | C124196 | C9H18O | 142.2 | 1402.1 | 748.498 | 1.9419 | rose, citrus, strong oily |
23 | 3 | unidentified | * | 0 | 1425.4 | 791.89 | 1.44527 | / |
24 | 4 | unidentified | * | 0 | 1411.7 | 766.005 | 1.26022 | / |
25 | 1-hexanol-M | C111273 | C6H14O | 102.2 | 1373.7 | 698.59 | 1.32522 | fresh, fruity, wine, sweet, green |
26 | 1-hexanol-D | C111273 | C6H14O | 102.2 | 1373.4 | 698.21 | 1.64602 | fresh, fruity, wine, sweet, green |
27 | 5 | unidentified | * | 0 | 1386.2 | 720.223 | 1.10028 | / |
28 | 2-methyl-2-hepten-6-one | C110930 | C8H14O | 126.2 | 1354.9 | 667.545 | 1.17293 | citrus, fruity, moldy, ketone |
29 | 3-Hydroxy-2-butanone-D | C513860 | C4H8O2 | 88.1 | 1292.8 | 572.967 | 1.32387 | butter, cream |
30 | 3-Hydroxy-2-butanone-M | C513860 | C4H8O2 | 88.1 | 1291.9 | 571.182 | 1.06837 | butter, cream |
31 | 1-Octen-3-one | C4312996 | C8H14O | 126.2 | 1318.1 | 610.458 | 1.27406 | strong earthy, mushroom, vegetable, fishy, chicken |
32 | Cyclohexanone-M | C108941 | C6H10O | 98.1 | 1292.8 | 572.967 | 1.15354 | strong, pungent, earthy |
33 | Cyclohexanone-D | C108941 | C6H10O | 98.1 | 1294.6 | 576.538 | 1.45082 | strong, pungent, earthy |
34 | 6 | unidentified | * | 0 | 1300.2 | 584.571 | 1.63401 | / |
35 | 1-Pentanol-D | C71410 | C5H12O | 88.1 | 1260.8 | 514.052 | 1.51188 | balsamic |
36 | 1-Pentanol-M | C71410 | C5H12O | 88.1 | 1261.3 | 514.945 | 1.25317 | balsamic |
37 | (E)-2-hexenal-D | C6728263 | C6H10O | 98.1 | 1227.5 | 459.155 | 1.51349 | green, banana, fat |
38 | (E)-2-hexenal-M | C6728263 | C6H10O | 98.1 | 1229.3 | 462.074 | 1.17803 | green, banana, fat |
39 | 2-pentyl furan | C3777693 | C9H14O | 138.2 | 1239.5 | 478.302 | 1.2495 | bean, fruity, earthy, green, vegetable |
40 | Heptaldehyde-D | C111717 | C7H14O | 114.2 | 1195.1 | 411.362 | 1.69333 | fresh, aldehyde, fatty, green herbs, wine, fruity |
41 | Heptaldehyde-M | C111717 | C7H14O | 114.2 | 1197 | 414.067 | 1.33789 | resh, aldehyde, fatty, green herbs, wine, fruity |
42 | Ethylbenzene-D | C100414 | C8H10 | 106.2 | 1145.6 | 345.742 | 1.44536 | aromatic odor |
43 | Ethylbenzene-M | C100414 | C8H10 | 106.2 | 1141.4 | 340.675 | 1.07501 | aromatic odor |
44 | Allyl sulfide | C592881 | C6H10S | 114.2 | 1138.3 | 336.989 | 1.33025 | garlic |
45 | hexanal-D | C66251 | C6H12O | 100.2 | 1097.7 | 292.071 | 1.54566 | fresh, green, fat, fruity |
46 | hexanal-M | C66251 | C6H12O | 100.2 | 1092.6 | 287.381 | 1.27156 | fresh, green, fat, fruity |
47 | 1,4-Dioxan | C123911 | C4H8O2 | 88.1 | 1081.9 | 278.003 | 1.13124 | pungent, ether |
48 | (Z)-4-heptenal | C6728310 | C7H12O | 112.2 | 1252.8 | 500.362 | 1.1452 | grass, oil |
49 | 2-Hexenal-D | C505577 | C6H10O | 98.1 | 1213.3 | 437.675 | 1.50904 | sweet almonds, fruity, green leaves, apples, plums, vegetables |
50 | 2-Hexenal-M | C505577 | C6H10O | 98.1 | 1213.7 | 438.253 | 1.18088 | sweet almonds, fruity, green leaves, apples, plums, vegetables |
51 | (Z)-2-Methylpent-2-enal-D | C623369 | C6H10O | 98.1 | 1161.8 | 366.033 | 1.48549 | aldehydes, soil, garlic, ripe cherries |
52 | (Z)-2-Methylpent-2-enal-M | C623369 | C6H10O | 98.1 | 1161.8 | 366.033 | 1.15671 | aldehydes, soil, garlic, ripe cherries, |
53 | 4-Heptanone-D | C123193 | C7H14O | 114.2 | 1170.2 | 377.008 | 1.57425 | fruity |
54 | 4-Heptanone-M | C123193 | C7H14O | 114.2 | 1170.2 | 377.008 | 1.22172 | fruity |
55 | Butanol-M | C71363 | C4H10O | 74.1 | 1154.7 | 357.01 | 1.17922 | wine |
56 | (E)-2-Pentenal-M | C1576870 | C5H8O | 84.1 | 1124.3 | 320.671 | 1.10921 | potato, peas |
57 | (E)-2-Pentenal-D | C1576870 | C5H8O | 84.1 | 1122.5 | 318.72 | 1.36298 | potato, peas |
58 | 2-hexanone-M | C591786 | C6H12O | 100.2 | 1116.8 | 312.379 | 1.19797 | fruity, fungal, meaty, buttery |
59 | 2-hexanone-D | C591786 | C6H12O | 100.2 | 1117 | 312.623 | 1.503 | fruity, fungal, meaty, buttery |
60 | 7 | unidentified | * | 0 | 1111.5 | 306.526 | 1.08806 | / |
61 | butyl acetate-M | C123864 | C6H12O2 | 116.2 | 1086.4 | 281.893 | 1.2377 | fruity |
62 | butyl acetate-D | C123864 | C6H12O2 | 116.2 | 1084.5 | 280.186 | 1.61745 | fruity |
63 | 2,5-Dimethyl thiophene | C638028 | C6H8S | 112.2 | 1187.1 | 400.177 | 1.07926 | nutty, sulfury |
64 | 8 | unidentified | * | 0 | 1061.4 | 260.8 | 1.19748 | / |
65 | Propanol-M | C71238 | C3H8O | 60.1 | 1049.9 | 251.667 | 1.11275 | alcohol, pungent |
66 | Propanol-D | C71238 | C3H8O | 60.1 | 1049.2 | 251.141 | 1.25578 | alcohol, pungent |
67 | 1-Penten-3-one-D | C1629589 | C5H8O | 84.1 | 1038.8 | 243.136 | 1.3087 | strong, pungent odors |
68 | 1-Penten-3-one-M | C1629589 | C5H8O | 84.1 | 1040.6 | 244.541 | 1.0782 | strong, pungent odors |
69 | Ethanol | C64175 | C2H6O | 46.1 | 937.8 | 182.624 | 1.11856 | aromaticity |
70 | 3-Methyl butanal | C590863 | C5H10O | 86.1 | 931.5 | 179.591 | 1.39948 | chocolate, fat |
71 | 2-Pentanone | C107879 | C5H10O | 86.1 | 1020.5 | 229.743 | 1.38929 | acetone, fresh, sweet fruity, wine |
72 | 2,3-Butanedione | C431038 | C4H6O2 | 86.1 | 991.4 | 210.382 | 1.17293 | butter, popcorn, sweet taste, sour rice |
73 | Valeraldehyde | C110623 | C5H10O | 86.1 | 1000.6 | 215.981 | 1.41874 | green grassy, faint banana, pungent |
74 | 9 | unidentified | * | 0 | 1050.8 | 252.37 | 0.94639 | / |
75 | 10 | unidentified | * | 0 | 1012.2 | 223.912 | 1.08232 | / |
76 | Propanal | C123386 | C3H6O | 58.1 | 815.5 | 132.229 | 1.13813 | pungent, green grassy |
77 | 2-propanone | C67641 | C3H6O | 58.1 | 837.9 | 140.273 | 1.11396 | fresh, apple, pear |
78 | 11 | unidentified | * | 0 | 763.6 | 115.309 | 1.13289 | / |
79 | 12 | unidentified | * | 0 | 712.2 | 100.659 | 1.14176 | / |
80 | 1-heptene | C592767 | C7H14 | 98.2 | 786.5 | 122.467 | 1.08648 | gasoline |
81 | 13 | unidentified | * | 0 | 792.8 | 124.54 | 1.1205 | / |
82 | 2-Methyl propanal | C78842 | C4H8O | 72.1 | 830.7 | 137.617 | 1.27928 | banana, melon, slightly nutty |
83 | 14 | unidentified | * | 0 | 853.6 | 146.206 | 1.15295 | / |
84 | Butanal | C123728 | C4H8O | 72.1 | 893.8 | 162.566 | 1.27842 | pungent, fruity, green leaf |
85 | Acetic acid ethyl ester | C141786 | C4H8O2 | 88.1 | 900.1 | 165.289 | 1.33457 | fresh, fruity, sweet, grassy |
86 | 15 | unidentified | * | 0 | 798 | 126.256 | 0.96012 | / |
87 | 2-Butanone-D | C78933 | C4H8O | 72.1 | 917.5 | 173.073 | 1.24453 | fruity, camphor |
88 | 2-Butanone-M | C78933 | C4H8O | 72.1 | 916.7 | 172.686 | 1.0679 | fruity, camphor |
89 | 16 | unidentified | * | 0 | 868.1 | 151.895 | 1.05772 | / |
90 | 3-Methyl-2-butenal-M | C107868 | C5H8O | 84.1 | 1212 | 435.627 | 1.09106 | fruity |
91 | 3-Methyl-2-butenal-D | C107868 | C5H8O | 84.1 | 1210.7 | 433.784 | 1.35477 | fruity |
92 | 4-Methyl-2-pentanone | C108101 | C6H12O | 100.2 | 1023.5 | 231.888 | 1.47906 | ketone |
93 | 2-hydroxy-2-methyl-4-pentanone-M | C123422 | C6H12O2 | 116.2 | 1372.5 | 696.599 | 1.13723 | mild, pleasant |
94 | 2-hydroxy-2-methyl-4-pentanone-D | C123422 | C6H12O2 | 116.2 | 1372.4 | 696.508 | 1.52947 | mild, pleasant |
95 | Hexyl propanoate | C2445763 | C9H18O2 | 158.2 | 1349.2 | 658.425 | 1.42698 | sweet fruity, earthy, pungent aroma resembling rotten fruits |
96 | ethyl 2-oxopropanoate | C617356 | C5H8O3 | 116.1 | 1277.1 | 543.21 | 1.15559 | fruity, sweet rum, vegetable caramel |
97 | Octanal-M | C124130 | C8H16O | 128.2 | 1303.7 | 589.545 | 1.41017 | aldehyde, waxy, citrus, orange, fruity |
98 | Octanal-D | C124130 | C8H16O | 128.2 | 1303.4 | 589.119 | 1.81914 | aldehyde, waxy, citrus, orange, fruity |
99 | 17 | unidentified | * | 0 | 1195.6 | 412.137 | 1.43025 | / |
100 | 18 | unidentified | * | 0 | 1320.8 | 614.48 | 1.15761 | / |
101 | 19 | unidentified | * | 0 | 996.8 | 213.472 | 1.10373 | / |
102 | 20 | unidentified | * | 0 | 1112.5 | 307.631 | 1.34941 | / |
103 | 21 | unidentified | * | 0 | 1098.2 | 292.531 | 1.36487 | / |
104 | 22 | unidentified | * | 0 | 997.2 | 213.687 | 1.46595 | / |
105 | 2-Methyl-1-propanol | C78831 | C4H10O | 74.1 | 1104.5 | 299.062 | 1.17395 | fresh, alcoholic, leather |
106 | 23 | unidentified | * | 0 | 1107.3 | 302.095 | 1.10657 | / |
107 | 24 | unidentified | * | 0 | 1067 | 265.431 | 1.80481 | / |
108 | (E)-2-octenal-D | C2548870 | C8H14O | 126.2 | 1427.1 | 795.165 | 1.81291 | fresh cucumber, fatty, green herbal, banana, green leaf |
109 | (E)-2-octenal-M | C2548870 | C8H14O | 126.2 | 1426.7 | 794.437 | 1.33114 | fresh cucumber, fatty, green herbal, banana, green leaf |
110 | 25 | unidentified | * | 0 | 1410.5 | 763.929 | 1.77584 | / |
111 | 26 | unidentified | * | 0 | 1357.7 | 671.983 | 1.10533 | / |
2-methoxy-3-sec-butyl | moldy, green, vegetable, nutty, | |||||||
112 | pyrazine | C24168705 | C9H14N2O | 166.2 | 1509.3 | 970.767 | 1.26067 | pepper, potato, fishy, galbanum |
113 | 2-ethyl-1-hexanol | C104767 | C8H18O | 130.2 | 1513.4 | 980.45 | 1.40846 | citrus, fresh floral, greasy |
114 | 27 | unidentified | * | 0 | 1436.3 | 813.124 | 1.1974 | / |
115 | 2-Methyl propanoic acid | C79312 | C4H8O2 | 88.1 | 1576.7 | 1143.045 | 1.15493 | yogurt, rancid cream |
116 | (E,E)-2,4-hexadienal | C142836 | C6H8O | 96.1 | 1408.6 | 760.381 | 1.1187 | sweet, green, floral, citrus |
117 | 28 | unidentified | * | 0 | 1252.9 | 500.488 | 1.20531 | / |
118 | (E)-2-Heptenal-M | C18829555 | C7H12O | 112.2 | 1340.8 | 645.07 | 1.25453 | spicy, green vegetables, fresh, fatty |
119 | Butanol-D | C71363 | C4H10O | 74.1 | 1153.9 | 356.001 | 1.38279 | wine |
120 | 29 | unidentified | * | 0 | 1146.7 | 347.035 | 1.11051 | / |
121 | 1-Butanol, 3-methyl | C123513 | C5H12O | 88.1 | 1217.5 | 443.959 | 1.24245 | whiskey, banana, fruity |
122 | 30 | unidentified | * | 0 | 897.1 | 164.007 | 1.0438 | / |
123 | 31 | unidentified | * | 0 | 1083.1 | 279 | 1.51066 | / |
124 | Linalyl acetate | C115957 | C12H20O2 | 196.3 | 1547.5 | 1064.871 | 1.21531 | lily of the valley, lavender |
Sample | Aldehydes | Alcohols | Acids | Ketones | Hydrocarbon | Esters | Heterocycle | Unknown |
---|---|---|---|---|---|---|---|---|
BU | 45.58 ± 0.30 d | 18.26 ± 0.30 d | 10.84 ± 0.91 c | 16.33 ± 0.25 b | 1.56 ± 0.05 a | 3.76 ± 0.23 a | 0.86 ± 0.03 b | 2.80 ± 0.14 a |
ST | 38.09 ± 0.10 a | 17.12 ± 0.05 c | 12.16 ± 0.26 c | 14.85 ± 0.08 a | 2.83 ± 0.07 b | 9.98 ± 0.11 c | 1.47 ± 0.05 c | 3.50 ± 0.03 b |
LE | 42.29 ± 0.12 c | 14.50 ± 0.12 b | 7.10 ± 0.78 b | 21.86 ± 0.52 d | 6.33 ± 0.07 d | 4.18 ± 0.11 b | 0.34 ± 0.03 a | 3.40 ± 0.12 b |
FL | 39.28 ± 0.19 b | 8.74 ± 0.62 a | 4.35 ± 0.32 a | 18.01 ± 0.19 c | 3.35 ± 0.03 c | 22.53 ± 0.12 d | 0.38 ± 0.01 a | 3.35 ± 0.16 b |
BBU | 30.68 ± 0.27 a | 18.98 ± 0.12 c | 8.88 ± 0.52 c | 35.16 ± 0.33 e | 0.62 ± 0.03 a | 0.76 ± 0.04 a | 1.02 ± 0.19 b | 3.90 ± 0.19 a |
BST | 54.51 ± 0.49 d | 17.87 ± 0.14 b | 4.40 ± 0.31 a | 14.92 ± 0.55 a | 1.25 ± 0.04 b | 0.81 ± 0.06 a | 1.83 ± 0.07 c | 4.42 ± 0.45 a |
BLE | 30.13 ± 0.32 a | 21.92 ± 0.34 e | 7.20 ± 0.27 b | 28.96 ± 0.92 d | 1.91 ± 0.04 d | 1.73 ± 0.02 b | 0.96 ± 0.08 b | 7.19 ± 0.50 b |
UBU | 33.45 ± 0.81 b | 20.20 ± 0.21 d | 6.55 ± 0.60 b | 28.01 ± 0.16 d | 1.49 ± 0.03 c | 2.02 ± 0.01 c | 0.80 ± 0.02 b | 7.48 ± 0.20 b |
UST | 40.84 ± 0.26 c | 13.09 ± 0.18 a | 3.66 ± 0.33 a | 25.89 ± 0.26 c | 6.38 ± 0.13 e | 2.55 ± 0.02 e | 0.49 ± 0.08 a | 7.10 ± 0.15 b |
ULE | 29.86 ± 0.59 a | 18.04 ± 0.31 b | 7.16 ± 0.35 b | 24.23 ± 0.48 b | 8.04 ± 0.11 f | 2.22 ± 0.12 d | 2.01 ± 0.08 c | 8.44 ± 0.35 c |
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Li, X.; Wang, Z.; Hou, C.; Gong, X.; Liu, Z.; Shi, Y.; Yan, J.; Tong, Q. Identification and Characterization of Volatile Organic Compounds Based on GC-IMS Technology in Different Organs of Lilium brownii var. viridulum and After Bud-Removal and Non-Bud-Removal Treatments. Molecules 2025, 30, 1238. https://doi.org/10.3390/molecules30061238
Li X, Wang Z, Hou C, Gong X, Liu Z, Shi Y, Yan J, Tong Q. Identification and Characterization of Volatile Organic Compounds Based on GC-IMS Technology in Different Organs of Lilium brownii var. viridulum and After Bud-Removal and Non-Bud-Removal Treatments. Molecules. 2025; 30(6):1238. https://doi.org/10.3390/molecules30061238
Chicago/Turabian StyleLi, Xiaoling, Zhihui Wang, Chaowen Hou, Xiujuan Gong, Zexiang Liu, Yuhe Shi, Jianye Yan, and Qiaozhen Tong. 2025. "Identification and Characterization of Volatile Organic Compounds Based on GC-IMS Technology in Different Organs of Lilium brownii var. viridulum and After Bud-Removal and Non-Bud-Removal Treatments" Molecules 30, no. 6: 1238. https://doi.org/10.3390/molecules30061238
APA StyleLi, X., Wang, Z., Hou, C., Gong, X., Liu, Z., Shi, Y., Yan, J., & Tong, Q. (2025). Identification and Characterization of Volatile Organic Compounds Based on GC-IMS Technology in Different Organs of Lilium brownii var. viridulum and After Bud-Removal and Non-Bud-Removal Treatments. Molecules, 30(6), 1238. https://doi.org/10.3390/molecules30061238